X-Git-Url: https://www.hackdaworld.org/gitweb/?a=blobdiff_plain;f=moldyn.h;h=3867fc0f604814b69425dd08463ee5b00f5096ea;hb=4e976ed83379d7cadc696012313abf3a31ea160f;hp=5a10197199f678df1670ce62fc33868a3382bad4;hpb=30fafe0cb366808315649bd07bfaa7133ca0ecd2;p=physik%2Fposic.git

diff --git a/moldyn.h b/moldyn.h
index 5a10197..3867fc0 100644
--- a/moldyn.h
+++ b/moldyn.h
@@ -491,6 +491,7 @@ int moldyn_load(t_moldyn *moldyn);
 int get_line(int fd,char *line,int max);
 
 int pair_correlation_init(t_moldyn *moldyn,double dr);
+int calculate_diffusion_coefficient(t_moldyn *moldyn,double *dc);
 int calculate_pair_correlation(t_moldyn *moldyn,double dr,void *ptr);
 
 int visual_init(t_moldyn *moldyn,char *filebase);